Butyl Carbamimidothioate

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Properties Simple | Detailed

Formula C5H12N2S
IUPAC Name 2-butylisothiourea
Molecular Mass 132.227 g·mol−1
Heat of Formation -9.2 ± 16.7 kJ·mol−1
Dipole Moment 2.68 ± 1.08 D
Volume 176.42 Å 3
Surface Area 183.29 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
Synonyms
  • (butylthio)formamidine
  • butylsulfanylformamidine
  • butylsulfanylmethanimidamide
  • s-n-butylisothiourea
CAS Number(s)
  • 2986-22-3
InChIKey BPMPPVUBRPXMNX-UHFFFAOYSA-N
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Elements H S C N